Benzonitrile, 2,4,6-trimethoxy-


Chemical Name: Benzonitrile, 2,4,6-trimethoxy-
CAS Number: 2571-54-2
Product Number: AG003FNH(AGN-PC-0JLPJY)
Synonyms:
MDL No:
Molecular Formula: C10H11NO3
Molecular Weight: 193.1992

Identification/Properties


Properties
MP:
143-145℃(lit.)
Form:
Solid
Computed Properties
Molecular Weight:
193.202g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
193.074g/mol
Monoisotopic Mass:
193.074g/mol
Topological Polar Surface Area:
51.5A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
209
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3439
Hazard Statements:
H301-H311-H331
Precautionary Statements:
P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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